3-N-(4,5-dimethyl-1H-pyrazol-3-yl)piperidine-1,3-dicarboxamide

C12H19N5O2 — CID 112689240

IUPAC3-N-(4,5-dimethyl-1H-pyrazol-3-yl)piperidine-1,3-dicarboxamide
SMILESCc1[nH]nc(NC(=O)C2CCCN(C(N)=O)C2)c1C
InChIInChI=1S/C12H19N5O2/c1-7-8(2)15-16-10(7)14-11(18)9-4-3-5-17(6-9)12(13)19/h9H,3-6H2,1-2H3,(H2,13,19)(H2,14,15,16,18)
InChIKeyBWKKWZONRWXXQB-UHFFFAOYSA-N
MW265.32 g/mol
LogP0.76
Rot. Bonds2

About 3-N-(4,5-dimethyl-1H-pyrazol-3-yl)piperidine-1,3-dicarboxamide

3-N-(4,5-dimethyl-1H-pyrazol-3-yl)piperidine-1,3-dicarboxamide (PubChem CID 112689240) has the molecular formula C12H19N5O2 and a molecular weight of 265.32 g/mol. Its IUPAC name is 3-N-(4,5-dimethyl-1H-pyrazol-3-yl)piperidine-1,3-dicarboxamide.

Molecular Properties

Compound Name3-N-(4,5-dimethyl-1H-pyrazol-3-yl)piperidine-1,3-dicarboxamide
PubChem CID112689240
Molecular FormulaC12H19N5O2
Molecular Weight265.32 g/mol
Exact Mass265.15
IUPAC Name3-N-(4,5-dimethyl-1H-pyrazol-3-yl)piperidine-1,3-dicarboxamide
SMILESCc1[nH]nc(NC(=O)C2CCCN(C(N)=O)C2)c1C
InChIInChI=1S/C12H19N5O2/c1-7-8(2)15-16-10(7)14-11(18)9-4-3-5-17(6-9)12(13)19/h9H,3-6H2,1-2H3,(H2,13,19)(H2,14,15,16,18)
InChIKeyBWKKWZONRWXXQB-UHFFFAOYSA-N
XLogP0.76
TPSA104.11 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 50.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-N-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine-1,3-dicarboxamide
CID 78927822
(3S)-N-(4,5-dimethyl-1H-pyrazol-3-yl)piperidine-3-carboxamide
CID 104618674
3-[(1-carbamoylpiperidine-3-carbonyl)amino]-1H-pyrazole-5-carboxylic acid
CID 64526678
3-N-(3-ethoxy-1H-1,2,4-triazol-5-yl)piperidine-1,3-dicarboxamide
CID 104817596
1-(2,2-dimethylpropanoyl)-N-(4,5-dimethyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide
CID 104620104
N-(4,5-dimethyl-1H-pyrazol-3-yl)oxolane-3-carboxamide
CID 115609939
4-[(1-carbamoylpiperidine-3-carbonyl)amino]benzoic acid
CID 43170125
(3S)-3-N-pyridin-2-ylpiperidine-1,3-dicarboxamide
CID 51927409
3-N-[2-(methylcarbamoyl)phenyl]piperidine-1,3-dicarboxamide
CID 43022872
(2S)-N-(4,5-dimethyl-1H-pyrazol-3-yl)piperidine-2-carboxamide
CID 104914702
1-(cyclopropanecarbonyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine-3-carboxamide
CID 78928337
methyl 1-carbamoylpiperidine-3-carboxylate
CID 66776661

Frequently Asked Questions

What is the IUPAC name of 3-N-(4,5-dimethyl-1H-pyrazol-3-yl)piperidine-1,3-dicarboxamide?
The IUPAC name of 3-N-(4,5-dimethyl-1H-pyrazol-3-yl)piperidine-1,3-dicarboxamide (CID 112689240) is 3-N-(4,5-dimethyl-1H-pyrazol-3-yl)piperidine-1,3-dicarboxamide.
What is the SMILES notation for 3-N-(4,5-dimethyl-1H-pyrazol-3-yl)piperidine-1,3-dicarboxamide?
The canonical SMILES for 3-N-(4,5-dimethyl-1H-pyrazol-3-yl)piperidine-1,3-dicarboxamide is Cc1[nH]nc(NC(=O)C2CCCN(C(N)=O)C2)c1C.
What is the InChIKey of 3-N-(4,5-dimethyl-1H-pyrazol-3-yl)piperidine-1,3-dicarboxamide?
The InChIKey is BWKKWZONRWXXQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O2/c1-7-8(2)15-16-10(7)14-11(18)9-4-3-5-17(6-9)12(13)19/h9H,3-6H2,1-2H3,(H2,13,19)(H2,14,15,16,18).
What are the key properties of 3-N-(4,5-dimethyl-1H-pyrazol-3-yl)piperidine-1,3-dicarboxamide?
3-N-(4,5-dimethyl-1H-pyrazol-3-yl)piperidine-1,3-dicarboxamide has a molecular weight of 265.32 g/mol, XLogP of 0.76, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(4,5-dimethyl-1H-pyrazol-3-yl)piperidine-1,3-dicarboxamide is sourced from PubChem (CID 112689240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).